SCHEMBL9735618

SCHEMBL9735618

O=C1CCC(C(=O)N2CCCN(CC(=O)N3CCOCC3)CC2)N1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 1/20 0.47
TSHR P16473 1/20 0.47
HSD17B10 Q99714 1/20 0.47
ALDH1A1 P00352 3/20 0.43
KDM4E B2RXH2 3/20 0.43
GAA P10253 2/20 0.39
LMNA P02545 2/20 0.39
RAB9A P51151 2/20 0.39
NAMPT P43490 2/20 0.39
TPSAB1 Q15661 1/20 0.39
TPSD1 Q9BZJ3 1/20 0.39
TPSG1 Q9NRR2 1/20 0.39
POLB P06746 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
PARP1 P09874 1/20 0.38
NPC1 O15118 2/20 0.38
CNR2 P34972 1/20 0.37
MITF O75030 1/20 0.37
HTT P42858 1/20 0.37
MAPT P10636 1/20 0.36

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL8824243 0.95 ALOX15 (0.51) ALOX15TSHRHSD17B10ALDH1A1KDM4E
SCHEMBL9734759 0.92 TSHR (0.56) ALOX15TSHRHSD17B10ALDH1A1KDM4E
SCHEMBL9734807 0.89 GAA (0.46) ALOX15TSHRHSD17B10ALDH1A1KDM4E
Fumaric Acid SCHEMBL9735616 0.89 TSHR (0.46) ALOX15TSHRHSD17B10ALDH1A1KDM4E
Fumaric Acid SCHEMBL9735611 0.89 TSHR (0.46) ALOX15TSHRHSD17B10ALDH1A1KDM4E
Maleic Acid SCHEMBL8824254 0.89 ALOX15 (0.45) ALOX15TSHRHSD17B10ALDH1A1KDM4E
SCHEMBL9735768 0.88 GAA (0.49) TSHRALDH1A1KDM4EGAALMNA
SCHEMBL9735396 0.88 GAA (0.51) ALOX15TSHRHSD17B10ALDH1A1GAA
SCHEMBL9734899 0.87 GAA (0.54) ALOX15TSHRHSD17B10ALDH1A1KDM4E
SCHEMBL8824284 0.84 KDM1A (0.41) ALOX15TSHRHSD17B10ALDH1A1KDM4E

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5102882-A Nootropic agents NIPPON SHINYAKU CO., LTD. (JP) 1992-04-07 US disclosed